[3-[(Z)-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]methyl]phenyl] furan-2-carboxylate

Formula:C25H29N7O3 Mutagenic:high Tumorigenic:high Reproductive Effective:high [3-[(Z)-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]methyl]phenyl] furan-2-carboxylate is not a drug-like molecule.

MolName	[3-[(Z)-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]methyl]phenyl] furan-2-carboxylate
MolecularFormula	C25H29N7O3
Smiles	O=C(c1ccco1)Oc1cc(/C=N\Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)ccc1
InChI	InChI=1S/C25H29N7O3/c33-22(21-11-8-16-34-21)35-20-10-7-9-19(17-20)18-26-30-23-27-24(31-12-3-1-4-13-31)29-25(28-23)32-14-5-2-6-15-32/h7-11,16-18H,1-6,12-15H2,(H,27,28,29,30)
InChIK	NYKBARJOFNJBDA-UHFFFAOYSA-N
TotalMolweight	475.551
Molweight	475.551
MonoisotopicMass	475.233188
CLogP	6.5477
CLogS	-6.471
H Acceptors	10
H Donors	1
TotalSurfaceArea	373.92
Relative PSA	0.26778
PolarSurfaceArea	108.98
Druglikeness	2.3083
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.51429
Fragments	1
Non HAtoms	35
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	11
Symmetricatoms	10
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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